Nitromesitylene

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Properties Simple | Detailed

Formula C9H11NO2
IUPAC Name 1,3,5-trimethyl-2-nitro-benzene
Molecular Mass 165.189 g·mol−1
Heat of Formation -45.4 ± 16.7 kJ·mol−1
Dipole Moment 5.01 ± 1.08 D
Volume 201.04 Å 3
Surface Area 195.72 Å 2
HOMO Energy -9.93 ± 0.55 eV
LUMO Energy 2.18 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,5-trimethyl-2-nitrobenzene
  • 2,4,6-trimethyl-1-nitrobenzene
  • 2,4,6-trimethylnitrobenzene
  • 2-nitromesitylene
  • benzene, 1,3,5-trimethyl-2-nitro-
  • mesitylene, 2-nitro-
  • mesitylene, 2-nitro- (8ci)
  • mononitromesitylene
CAS Number(s)
  • 603-71-4
InChIKey SCEKDQTVGHRSNS-UHFFFAOYSA-N
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